1-[2,3-bis(chloranyl)phenyl]sulfonyl-4-(thiophen-2-ylmethyl)-1,4-diazepane

Systemtic Name: 1-[2,3-bis(chloranyl)phenyl]sulfonyl-4-(thiophen-2-ylmethyl)-1,4-diazepane Openeye Name: 1-(2,3-dichlorophenyl)sulfonyl-4-(2-thienylmethyl)-1,4-diazepane CAS Name: 1-(2,3-dichlorophenyl)sulfonyl-4-(thiophen-2-ylmethyl)-1,4-diazepane IUPAC Name: 1-(2,3-dichlorophenyl)sulfonyl-4-(thiophen-2-ylmethyl)-1,4-diazepane Traditional Name: 1-(2,3-dichlorophenyl)sulfonyl-4-(2-thenyl)-1,4-diazepane Formula: C16H18Cl2N2O2S2 MolecularWeight: 405.36232

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=C(C(=CC=C2)Cl)Cl)CC3=CC=CS3

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=C(C(=CC=C2)Cl)Cl)CC3=CC=CS3

InChI

InChI=1S/C16H18Cl2N2O2S2/c17-14-5-1-6-15(16(14)18)24(21,22)20-8-3-7-19(9-10-20)12-13-4-2-11-23-13/h1-2,4-6,11H,3,7-10,12H2